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Correlation of ^1H NMR Chemical Shift for Aqueous Solutions by Statistical Associating Fluid Theory Association Model 被引量:2
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作者 许波 李浩然 +2 位作者 王从敏 许映杰 韩世钧 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2005年第2期280-284,共5页
1H NMR chemical shifts of binary aqueous mixtures of acylamide, alcohol, dimethyl sulphoxide (DMSO), and acetone are correlated by statistical associating fluid theory (SAFT) association model. The comparison between ... 1H NMR chemical shifts of binary aqueous mixtures of acylamide, alcohol, dimethyl sulphoxide (DMSO), and acetone are correlated by statistical associating fluid theory (SAFT) association model. The comparison between SAPT association model and Wilson equation shows that the former is better for dealing with aqueous solutions. Finally, the specialties of both models are discussed. 展开更多
关键词 Statistical associating fluid theory (SAFT) association model NMR chemical shift aqueous solution
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Representation of phase behavior of associating fluids using EOS
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作者 PANG Jianyuan ZUO Julian Y., ZHANG Dan D. 《Journal of Chemistry and Chemical Engineering》 2009年第10期1-6,32,共7页
Associating fluids containing water and alkanols show a strong non-ideal behaviour on thermodynamic properties Simple cubic equations of state (EOS). such as the Peng-Robinson (PR) equation, with conventional mixi... Associating fluids containing water and alkanols show a strong non-ideal behaviour on thermodynamic properties Simple cubic equations of state (EOS). such as the Peng-Robinson (PR) equation, with conventional mixing rules are popular lbr its simplicity and eas3' implementation. However it is incapable of reliably representing the phase behaviour of associating mixtures. An effort has been made in this study to develop a new model in which the non-densit3'-dependent mixing rules are applied to the PR EOS to represent the phase behaviour of associating fluids. The proposed model takes into account of the polarity in the attractive term of the EOS by including both the conventional random mixing term and the asymmetric interaction term. The proposed model has been successfully applied to the calculation of the vapor-liquid equilibrium (VLE) and liquid-liquid equilibrium (LLE) of fluids containing water, alkanols, acid gases, and hydrocarbons. A satisfactory agreement between the predictions of the proposed model and the experimental data in the literature is reached. 展开更多
关键词 associating fluids PR EOS asymmetric interaction term VLE LLE
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Association of neuroelectrophysiology and analysis of cerebrospinal fluid immunoglobulin with pathogenetic conditions of patients with Guillain-Barre syndrome
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作者 Haibin Huang Xunliang Mai Xiaohong Ye 《Neural Regeneration Research》 SCIE CAS CSCD 2006年第3期271-273,共3页
BACKGROUND: Guillain-Barre syndrome (GBS) is an autoimmune disease which is characterized by demyelination of peripheral nerve and nerve root, and inflammatory reaction of lymphocyte and macrophage. Neuroelectrophy... BACKGROUND: Guillain-Barre syndrome (GBS) is an autoimmune disease which is characterized by demyelination of peripheral nerve and nerve root, and inflammatory reaction of lymphocyte and macrophage. Neuroelectrophysiological examination and cerebrospinal fluid (CSF) analysis are of significance for its diagnosis. OBJECTIVE: To study the association of neuroelectrophysiology and cerebrospinal fluid immunoglobulin (CSF-lg) with pathogenetic conditions of patients with GBS. DESIGN: Case control study SETTING: Department of Neurology, Shenzhen Municipal Shekou Group Hospital; Department of Neuroelectrophysiology, People's Hospital of Guangdong Province. PARTICIPANTS: A total of 32 GBS patients including 18 males and 14 females who aged from 17 to 72 years were selected as experimental group from the Department of Neurology, People's Hospital of Guang- dong Province from January 2004 to December 2005. All cases conformed with GBS diagnostic criteria established by Asbury in 1990 and they were divided into three types according to neurological criteria established by Chinese Neurology and Psychology Journal in 1993: mild, moderate and severe types. Another 30 patients with vascular headache were selected as control group from the same hospital including 14 males and 16 females who aged from 17 to 79 years. METHODS: ① Neuroelectrophysiological examination: Multiple-functional electromyography device provided by Nicolet Company, USA was used to measure nerve conduction velocity (NCV), including motor nerve conduction velocity (MCV) and sensory nerve conduction velocity (SCV); meanwhile, electromyologram (EMG), somatosensory evoked potential (SEP) and electroencephalogram (EEG) were also measured. ② Detection of CSF-lg: Concentrations of IgG, IgA and IgM were measured with immunofixation electrophoresis. ③Follow-up: Among 32 GBS patients, 14 cases received follow-up after treatment and the longest fol- low-up time was 1 year after onset. Among them, 8 cases were reexaminined with neuroelectrophysiological and CSF examinations. MAIN OUTCOME MEASURES: Results of NCV, EMG, SEP and EEG; comparison of CSF-lg content; results of follow-up examinations. RESULTS: All 32 GBS cases and 30 patients with vascular headache were involved in the final analysis. ① Abnormal rate of neuroelectrophysiological test: 75% of NCV, 88% of F-wave, 53% of MCV, 25% of SEP, 47% of EMG and 31% of EEG. There were no significant differences among various types (P 〉 0.05). ② Results of CSF-lg test: There were no significant differences among various types (P 〉 0.05); however, abnormalities in experimental group was higher than those in control group (P 〈 0.01). CONCLUSION : Results of follow-up study suggest that improvement of clinical symptom is earlier than neuroelectrophysiological recovery; MCV and EMG recoveries are faster than that of NCV; the earlier the abnormality of EMG, the poorer the recovery. CSF4g recovers normally along improvement of clinical symptoms. It is of significance for neuroelectrophysiology and abnormality of CSF-Ig to determine degree of peripheral nerve demyelination and prognosis. 展开更多
关键词 CSF GBS Association of neuroelectrophysiology and analysis of cerebrospinal fluid immunoglobulin with pathogenetic conditions of patients with Guillain-Barre syndrome
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Equation oriented method for Rectisol wash modeling and analysis 被引量:3
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作者 高宁 翟持 +1 位作者 孙巍 张新宇 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2015年第9期1530-1535,共6页
Rectisol process is more efficient in comparison with other physical or chemical absorption methods for gas purification. To implement a real time simulation of Rectisol process, thermodynamic model and simulation str... Rectisol process is more efficient in comparison with other physical or chemical absorption methods for gas purification. To implement a real time simulation of Rectisol process, thermodynamic model and simulation strategy are needed. In this paper, a method of modified statistical associated fluid theory with perturbation theory is used to predict thermodynamic behavior of process. As Rectisol process is a highly heat-integrated process with many loops, a method of equation oriented strategy, sequential quadratic programming, is used as the solver and the process converges perfectly. Then analyses are conducted with this simulator. 展开更多
关键词 Rectisol process simulation Modified statistical associated fluid theory Equation oriented Sequential quadratic programming
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Changes in and effective factors of microtubule associated protein 2 in traumatic neurons 被引量:2
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作者 张相彤 刘恩重 +1 位作者 刘晓谦 戴钦舜 《Chinese Medical Journal》 SCIE CAS CSCD 2001年第10期27-30,104,共5页
Objective To investigate alterations in the microtubule-associated protein 2 (MAP-2) of neurons in Wistar rats and the effect of nimodipine (Nim), D-2-amino-5-phosphonovaleric acid (D-AP-5) and mild hypothermia on ne... Objective To investigate alterations in the microtubule-associated protein 2 (MAP-2) of neurons in Wistar rats and the effect of nimodipine (Nim), D-2-amino-5-phosphonovaleric acid (D-AP-5) and mild hypothermia on neuronal MAP-2 following fluid percussion injury (FPI).Methods Alterations of MAP-2 in Wistar rat neurons following FPI were measured by a confocal laserscanning microscope using MAP-2 immunofluorescence staining as a MAP-2 indicator.Results MAP-2 immunofluorescence staining was limited to the cell bodies and dendritic compartments of neurons and more intense in dendrites than in cell bodies. The loss of MAP-2 was marked at 3 h posttrauma ( P < 0.01 ), and reached a maximum at 48 h post-trauma. Afterwards, fluorescence recovered partly at 72 h post-trauma. The application of Nim markedly reduced the loss of MAP-2 immunoreectivity within 1 h post-trauma ( P < 0.01 ), and the application of D-AP-5 markedly reduced the loss of MAP-2immunoreactivity within 10 h post-injury ( P < 0.01 ). The application of mild hypothermia decreased the loss of MAP-2 immunoreactivity within 1 h post-injury (P< 0.05).Conclusions The partial recovery of fluorescence at 72 h post-trauma indicate that the partial structure of the neuronal microtubules can be repaired by itself. Nim, D-AP-5 and mild hypothermia reduce the degradation of MAP-2 by different mechanisms. The treatment of neuronal cytoskeleton degradation following FPI must employ multiple therapeutic approaches. 展开更多
关键词 fluid percussion injury · microtubule associated protein 2 · nimodipine · mild hypothermia · D 2 amino 5 phosphonovaleric acid
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Phase Equilibrium Calculation of Mixtures: Use of the SAFT-BACK Equation of State for Binary Systems under Elevated Pressure
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作者 张志禹 胡中桥 +1 位作者 杨基础 李以圭 《Tsinghua Science and Technology》 SCIE EI CAS 2002年第1期73-77,共5页
The statistical associating fluid theory (SAFT) Boublík Alder Chen Kreglewshi(BACK) equation of state is employed to correlate vapor liquid equilibria of 16 binary mixtures composed of supercritical fluid... The statistical associating fluid theory (SAFT) Boublík Alder Chen Kreglewshi(BACK) equation of state is employed to correlate vapor liquid equilibria of 16 binary mixtures composed of supercritical fluids with other fluids at elevated pressures. The van der Waals mixing rules are used and the binary parameters are adjusted to experimental data. The SAFT BACK equation of state provides a better correlation of vapor liquid equilibrium than the original BACK equation. Consequently, the binary parameters computed from the data sets can be used to accurately predict the saturated densities of the vapor and liquid phases. 展开更多
关键词 Boublík Alder Chen Kreglewshi (BACK) statistical associating fluid theory (SAFT) equation of state supercritical fluids vapor liquid equilbrium
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Phase Equilibrium Calculation of Mixtures: Comparison of SAFT, Modified SAFT, and BACK EOS for Supercritical CO_2-C_2H_5OH System
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作者 张志禹 胡中桥 +1 位作者 杨基础 李以圭 《Tsinghua Science and Technology》 SCIE EI CAS 2002年第1期69-72,共4页
Three calculational models, statistical associating fluid theory (SAFT), modified SAFT, and Boublík Alder Chen Kreglewshi (BACK) are compared for supercritical CO 2 C 2H 5OH using a set of van der Waals ... Three calculational models, statistical associating fluid theory (SAFT), modified SAFT, and Boublík Alder Chen Kreglewshi (BACK) are compared for supercritical CO 2 C 2H 5OH using a set of van der Waals type mixing rules for both the BACK equation of state (EOS) and the SAFT EOS. Equations are presented for the residual Helmholtz free energy, residual chemical potentials, and compressibilty factor for mixtures. A comparison with experimental vapor liquid equilibrium (VLE) data reveals that the BACK EOS together with the suggested mixing rules provides more accurate prediction of the binary system than the SAFT or the modified SAFT model with no adjustable binary parameters. The correlation results are improved with an adjustable parameter. 展开更多
关键词 mixing rules Boublík Alder Chen Kreglewshi (BACK) statistical associating fluid theory (SAFT) equation of state CO 2 C 2H 5OH
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An Analytic Equation of State Based on SAFT-CP for Binary Non-Polar Alkane Mixtures Across the Critical Point
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作者 周文来 密建国 +2 位作者 贺刚 于燕梅 陈健 《Tsinghua Science and Technology》 SCIE EI CAS 2003年第6期756-759,共4页
The description using an analytic equation of state of thermodynamic properties near the critical points of fluids and their mixtures remains a challenging problem in the area of chemical engineering. Based on the sta... The description using an analytic equation of state of thermodynamic properties near the critical points of fluids and their mixtures remains a challenging problem in the area of chemical engineering. Based on the statistical associating fluid theory across the critical point (SAFT-CP), an analytic equation of state is established in this work for non-polar mixtures. With two binary parameters, this equation of state can be used to calculate not only vapor-liquid equilibria but also critical properties of binary non-polar alkane mixtures with acceptable deviations. 展开更多
关键词 equation of state the statistical associating fluid theory across the critical point (SAFT-CP) critical point vapor-liquid equilibria
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